Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.54 |
| ▸ | CACNA1G | O43497 | 9/20 | 0.49 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.49 |
| ▸ | MEN1 | O00255 | 3/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | GLA | P06280 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | RAD52 | P43351 | 1/20 | 0.46 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.46 |
| ▸ | RRM1 | P23921 | 1/20 | 0.45 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL9435578 | 1.00 | TSHR (0.54) | TSHRCACNA1GKCNH2MEN1KMT2A | |
| SCHEMBL9435774 | 0.96 | TSHR (0.51) | TSHRCACNA1GKCNH2MEN1KMT2A | |
| SCHEMBL9435768 | 0.96 | TSHR (0.51) | TSHRCACNA1GKCNH2MEN1KMT2A | |
| SCHEMBL9435498 | 0.95 | MEN1 (0.56) | TSHRCACNA1GKCNH2MEN1KMT2A | |
| SCHEMBL9435494 | 0.95 | MEN1 (0.56) | TSHRCACNA1GKCNH2MEN1KMT2A | |
| SCHEMBL9098357 | 0.95 | TSHR (0.52) | TSHRCACNA1GKCNH2MEN1KMT2A | |
| SCHEMBL9098349 | 0.95 | TSHR (0.52) | TSHRCACNA1GKCNH2MEN1KMT2A | |
| SCHEMBL9098366 | 0.95 | TSHR (0.52) | TSHRCACNA1GKCNH2MEN1KMT2A | |
| SCHEMBL9435534 | 0.89 | CACNA1G (0.57) | TSHRCACNA1GKCNH2MAPT | |
| SCHEMBL9435539 | 0.89 | CACNA1G (0.57) | TSHRCACNA1GKCNH2MAPT |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5371088-A | 1-aryl-4-piperazinylcyclohexanecarbonitriles, the preparation and use thereof | BASF AKTIENGESELLSCHAFT (DE) | 1994-12-06 | — | — | US | disclosed |